CID 730810

4-hydroxy-6-methyl-2-phenylquinoline

Structural Information

Molecular Formula
C16H13NO
SMILES
CC1=CC2=C(C=C1)NC(=CC2=O)C3=CC=CC=C3
InChI
InChI=1S/C16H13NO/c1-11-7-8-14-13(9-11)16(18)10-15(17-14)12-5-3-2-4-6-12/h2-10H,1H3,(H,17,18)
InChIKey
SWRQHHJAXCNFGU-UHFFFAOYSA-N
Compound name
6-methyl-2-phenyl-1H-quinolin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

11
References

30
Patents

235.09972 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 236.10700 151.6
[M+Na]+ 258.08894 161.4
[M-H]- 234.09244 157.1
[M+NH4]+ 253.13354 168.5
[M+K]+ 274.06288 155.2
[M+H-H2O]+ 218.09698 143.6
[M+HCOO]- 280.09792 172.6
[M+CH3COO]- 294.11357 164.2
[M+Na-2H]- 256.07439 159.2
[M]+ 235.09917 150.6
[M]- 235.10027 150.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe